(4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine

C17H33N — CID 89202149

IUPAC(4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine
SMILESCCC/C=C\C(NCCC)=C(/CCC)CCCC
InChIInChI=1S/C17H33N/c1-5-9-11-14-17(18-15-8-4)16(12-7-3)13-10-6-2/h11,14,18H,5-10,12-13,15H2,1-4H3/b14-11-,17-16-
InChIKeyXLXOAVBWOSZHQZ-SJKKTQPASA-N
MW251.46 g/mol
LogP5.59
Rot. Bonds11

About (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine

(4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine (PubChem CID 89202149) has the molecular formula C17H33N and a molecular weight of 251.46 g/mol. Its IUPAC name is (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine.

Molecular Properties

Compound Name(4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine
PubChem CID89202149
Molecular FormulaC17H33N
Molecular Weight251.46 g/mol
Exact Mass251.26
IUPAC Name(4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine
SMILESCCC/C=C\C(NCCC)=C(/CCC)CCCC
InChIInChI=1S/C17H33N/c1-5-9-11-14-17(18-15-8-4)16(12-7-3)13-10-6-2/h11,14,18H,5-10,12-13,15H2,1-4H3/b14-11-,17-16-
InChIKeyXLXOAVBWOSZHQZ-SJKKTQPASA-N
XLogP5.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500251.46
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine?
The IUPAC name of (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine (CID 89202149) is (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine.
What is the SMILES notation for (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine?
The canonical SMILES for (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine is CCC/C=C\C(NCCC)=C(/CCC)CCCC.
What is the InChIKey of (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine?
The InChIKey is XLXOAVBWOSZHQZ-SJKKTQPASA-N. The full InChI is InChI=1S/C17H33N/c1-5-9-11-14-17(18-15-8-4)16(12-7-3)13-10-6-2/h11,14,18H,5-10,12-13,15H2,1-4H3/b14-11-,17-16-.
What are the key properties of (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine?
(4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine has a molecular weight of 251.46 g/mol, XLogP of 5.59, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z,6Z)-N,7-dipropylundeca-4,6-dien-6-amine is sourced from PubChem (CID 89202149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).